(-)-二丙酮-2-酮-L-古洛糖酸单水合物
TL;DR: (-)-二丙酮-2-酮-L-古洛糖酸单水合物 (CAS 68539-16-2) is a chemical compound with molecular formula C12H18O7 and molecular weight 274.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(-)-二丙酮-2-酮-L-古洛糖酸单水合物
4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid
Also Known As: Dikegulac, Diprogulic Acid, Dikegulac acid, (-)-Diacetone-2-keto-L-gulonic acid monohydrate, 4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid
| Molecular Formula | C12H18O7 |
|---|---|
| Molecular Weight | 274.11 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.10526 |
| Heavy Atoms | 19 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 68539-16-2 |
|---|---|
| SMILES | CC1(OCC2C(O1)C3C(O2)(OC(O3)(C)C)C(=O)O)C |
| InChIKey | FWCBATIDXGJRMF-UHFFFAOYSA-N |
Product Overview
(-)-二丙酮-2-酮-L-古洛糖酸单水合物 (CAS 68539-16-2), with molecular formula C12H18O7 and molecular weight 274.11 g/mol. IUPAC: 4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[6.4.0.02,6]dodecane-6-carboxylic acid.
Chemical Property Profile of (-)-二丙酮-2-酮-L-古洛糖酸单水合物
Property Insights of (-)-二丙酮-2-酮-L-古洛糖酸单水合物
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (-)-二丙酮-2-酮-L-古洛糖酸单水合物. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for (-)-二丙酮-2-酮-L-古洛糖酸单水合物. Following Lipinski's Rule of Five, (-)-二丙酮-2-酮-L-古洛糖酸单水合物 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (-)-二丙酮-2-酮-L-古洛糖酸单水合物?
The CAS number of (-)-二丙酮-2-酮-L-古洛糖酸单水合物 is 68539-16-2.
What is the molecular formula of (-)-二丙酮-2-酮-L-古洛糖酸单水合物?
The molecular formula of (-)-二丙酮-2-酮-L-古洛糖酸单水合物 is C12H18O7.
What is the molecular weight of (-)-二丙酮-2-酮-L-古洛糖酸单水合物?
The molecular weight of (-)-二丙酮-2-酮-L-古洛糖酸单水合物 is 274.11 g/mol.
Where can I buy (-)-二丙酮-2-酮-L-古洛糖酸单水合物?
You can request a quote for (-)-二丙酮-2-酮-L-古洛糖酸单水合物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-二丙酮-2-酮-L-古洛糖酸单水合物?
Yes, KEHONG BIO provides custom synthesis services for (-)-二丙酮-2-酮-L-古洛糖酸单水合物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.